4-[(3,5,5,8,8-pentamethyl-6,7-dihydronaphthalen-2-yl)carbothioyl]benzoic acid

Systemtic Name: 4-[(3,5,5,8,8-pentamethyl-6,7-dihydronaphthalen-2-yl)carbothioyl]benzoic acid Openeye Name: 4-(1,1,4,4,7-pentamethyltetralin-6-carbothioyl)benzoic acid CAS Name: 4-[(3,5,5,8,8-pentamethyl-6,7-dihydronaphthalen-2-yl)-sulfanylidenemethyl]benzoic acid IUPAC Name: 4-(3,5,5,8,8-pentamethyl-6,7-dihydronaphthalene-2-carbothioyl)benzoic acid Traditional Name: 4-(1,1,4,4,7-pentamethyltetralin-6-carbothioyl)benzoic acid Formula: C23H26O2S MolecularWeight: 366.51634

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1C(=S)C3=CC=C(C=C3)C(=O)O)C(CCC2(C)C)(C)C

Isomeric SMILES

CC1=CC2=C(C=C1C(=S)C3=CC=C(C=C3)C(=O)O)C(CCC2(C)C)(C)C

InChI

InChI=1S/C23H26O2S/c1-14-12-18-19(23(4,5)11-10-22(18,2)3)13-17(14)20(26)15-6-8-16(9-7-15)21(24)25/h6-9,12-13H,10-11H2,1-5H3,(H,24,25)